This profile is built from public research funding records (CIHR, NSERC and SSHRC) and PubMed. We have not imported them from a University of Calgary directory, so their courses may be missing. Find their university profile.
Research
Latest papers
The rocky path of DFT into chemistry-Discussions at a symposium and reflections on a circular journey in honor of Axel Becke 1953-2025.
The Journal of chemical physics · 2026
System-Specific Parameter Optimization for Nonpolarizable and Polarizable Force Fields.
Journal of chemical theory and computation · 2024
Radical pairs may explain reactive oxygen species-mediated effects of hypomagnetic field on neurogenesis.
PLoS computational biology · 2022
Latest funding
- $200,000
Nanobubble enrichment of water-in-diesel nanoemulsions
NSERC · 2021 · Co-investigator
- $288,000
Multiscale modeling of (bio)catalytic systems
NSERC · 2019 · Principal investigator
- $12,500
Hydrorefined fuel - computational insight into the mechanism
NSERC · 2018 · Principal investigator
9 publications.
The rocky path of DFT into chemistry-Discussions at a symposium and reflections on a circular journey in honor of Axel Becke 1953-2025.
Nordholm S, Baerends EJ, Burke K, Gill P, Gori-Giorgi P, Grimme S, Head-Gordon M, Helgaker T, Johnson E, Jones RO, Perdew J, Salahub D, Savin A, Scuseria G, Tozer DJ, Yang W, Boyd RJ, Schaefer HF
System-Specific Parameter Optimization for Nonpolarizable and Polarizable Force Fields.
Hu X, Amin KS, Schneider M, Lim C, Salahub D, Baldauf C
Radical pairs may explain reactive oxygen species-mediated effects of hypomagnetic field on neurogenesis.
Rishabh R, Zadeh-Haghighi H, Salahub D, Simon C
Radical pairs may play a role in xenon-induced general anesthesia.
Smith J, Zadeh Haghighi H, Salahub D, Simon C
Measurement and prediction of quantum coherence effects in biological processes.
de la Lande A, Moliner V, Salahub D
The QM-MM interface for CHARMM-deMon.
Lev B, Zhang R, de la Lande A, Salahub D, Noskov SY
Semiempirical Quantum Chemical PM6 Method Augmented by Dispersion and H-Bonding Correction Terms Reliably Describes Various Types of Noncovalent Complexes.
Řezáč J, Fanfrlík J, Salahub D, Hobza P
Delay stochastic simulation of single-gene expression reveals a detailed relationship between protein noise and mean abundance.
Zhu R, Salahub D
Studying genetic regulatory networks at the molecular level: delayed reaction stochastic models.
Zhu R, Ribeiro AS, Salahub D, Kauffman SA
Nanobubble enrichment of water-in-diesel nanoemulsions
Principal investigators: Kusalik, Peter PG
Multiscale modeling of (bio)catalytic systems
Principal investigators: Salahub, Dennis
Keywords: biomolecular systems; computational chemistry; density functional theory; electronic response in polarizable environments; enzymes; molecular dynamics; multiscale modeling; nanocatalysis; oil sands upgrading; transition metals
Hydrorefined fuel - computational insight into the mechanism
Principal investigators: Salahub, Dennis
Hydrorefined fuel - computational insight into the mechanism
Principal investigators: Salahub, Dennis
Multiscale modeling of (bio) catalytic systems
Principal investigators: Salahub, Dennis
Compute Canada / Calcul Canada
Principal investigators: Sénéchal, David
Multiscale modeling of (bio) catalyic systems
Principal investigators: Salahub, Dennis
Multiscale Computational Materials Design - Ultra-Dispersed catalysts for in-situ upgrading - CIAM
Principal investigators: Salahub, Dennis
Modeling (bio)molecular interactions with quantum mechanics and taking account of environmental effects
Principal investigators: Salahub, Dennis
Modeling biomolecular interactions with quantum mechanics and taking account of environmental effects
Principal investigators: Salahub, Dennis
From CIHR, NSERC and SSHRC funding decisions: CIHR since 2008, NSERC since 1991 and SSHRC since 1998, including their latest published competition results.
Frequent collaborators
- Christoph Simon and Dennis Salahub: 2 shared papers
- Erin Johnson and Dennis Salahub: 1 shared paper
- Chemistry
- Physics and Astronomy
Co-authors at University of Calgary, colored by department. Thicker lines mean more shared papers; select anyone to open their profile and their own map.
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